3-[3-(3-methoxyphenyl)-2-methyl-1-oxidanylidene-isoquinolin-4-yl]-N-methyl-propanamide

Systemtic Name: 3-[3-(3-methoxyphenyl)-2-methyl-1-oxidanylidene-isoquinolin-4-yl]-N-methyl-propanamide Openeye Name: 3-[3-(3-methoxyphenyl)-2-methyl-1-oxo-4-isoquinolyl]-N-methyl-propanamide CAS Name: 3-[3-(3-methoxyphenyl)-2-methyl-1-oxo-4-isoquinolinyl]-N-methylpropanamide IUPAC Name: 3-[3-(3-methoxyphenyl)-2-methyl-1-oxoisoquinolin-4-yl]-N-methylpropanamide Traditional Name: 3-[1-keto-3-(3-methoxyphenyl)-2-methyl-4-isoquinolyl]-N-methyl-propionamide Formula: C21H22N2O3 MolecularWeight: 350.41098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CCC1=C(N(C(=O)C2=CC=CC=C21)C)C3=CC(=CC=C3)OC

Isomeric SMILES

CNC(=O)CCC1=C(N(C(=O)C2=CC=CC=C21)C)C3=CC(=CC=C3)OC

InChI

InChI=1S/C21H22N2O3/c1-22-19(24)12-11-17-16-9-4-5-10-18(16)21(25)23(2)20(17)14-7-6-8-15(13-14)26-3/h4-10,13H,11-12H2,1-3H3,(H,22,24)